GL1X · GenesisL1 explorer

MolNFT v1 · #146000 · protein

N-GTPase domain of P190RHOGAP-a

6D4G · Rho GTPase-activating protein 35: “N-GTPase domain of P190RHOGAP-a”. X-ray diffraction, 2 ligands (GTP, MG), 5 pockets (best druggability 0.71). MolNFT v1 #146000 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6D4G
Type
protein
Length
418 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Rho GTPase-activating protein 35
UniProt
P81128
Ligands
GTP, MG
Pockets
5 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains · 35% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARho GTPase-activating protein 35protein23132% helix, 23% strandP81128
BRho GTPase-activating protein 35protein18738% helix, 18% strandP81128

Ligands and binding sites

  • GTP · Guanosine-5'-triphosphate · ligand · 2 copies · chains A, B
  • MG · Magnesium ion · metal · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

5 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15350.710.8057GTP
22570.590.7931GTP, MG
31870.550.7923empty
41130.430.7720empty
5770.330.7518empty

Interfaces

1 interface between chains.

  • A–B · 505 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6D4G · N-GTPase domain of p190RhoGAP-A · the same entry in another collection · chain A against A, TM-score 1.00
  • P81128 · AlphaFold monomer V2.0 prediction for rho GTPase-activating protein 35 (P81128) · a predicted model of the same protein · chain B against A, TM-score 0.99

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